SCHEMBL1968819

SCHEMBL1968819

CCCCc1nnc(N)s1

nearest known ligand 0.92

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.88
POLB P06746 4/20 0.75
GLS O94925 2/20 0.57
L3MBTL1 Q9Y468 1/20 0.52
GAA P10253 1/20 0.52
ATM Q13315 1/20 0.50
KDM4E B2RXH2 1/20 0.47
RAB9A P51151 1/20 0.47
F2 P00734 1/20 0.45
HTT P42858 1/20 0.44
HSD17B10 Q99714 1/20 0.44

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
Hydrochloric Acid SCHEMBL20475888 0.98 ALDH1A1 (0.85) ALDH1A1POLBGLSL3MBTL1GAA
SCHEMBL11412602 0.96 ALDH1A1 (0.96) ALDH1A1POLBGLSL3MBTL1GAA
SCHEMBL11425081 0.94 ALDH1A1 (1.00) ALDH1A1POLBGLSL3MBTL1GAA
SCHEMBL9470312 0.94 ALDH1A1 (1.00) ALDH1A1POLBGLSL3MBTL1GAA
SCHEMBL28058879 0.94 ALDH1A1 (1.00) ALDH1A1POLBGLSL3MBTL1GAA
SCHEMBL23016888 0.94 ALDH1A1 (1.00) ALDH1A1POLBGLSL3MBTL1GAA
SCHEMBL7161882 0.88
SCHEMBL14977428 0.88 ALDH1A1 (0.86) ALDH1A1POLBGLSL3MBTL1GAA
SCHEMBL14975757 0.88 ALDH1A1 (0.95) ALDH1A1POLBGLSL3MBTL1GAA
SCHEMBL15709879 0.86 ALDH1A1 (1.00) ALDH1A1POLBGLSL3MBTL1GAA

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 10 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11149203-B2 Liquid crystal composition containing a five-membered heterocyclic ring, reverse-mode polymer dispersed liquid crystal element, and associated selectively dimmable device NITTO DENKO CORPORATION (JP) 2021-10-19 US disclosed
US-11149203-B2 Liquid crystal composition containing a five-membered heterocyclic ring, reverse-mode polymer dispersed liquid crystal element, and associated selectively dimmable device NITTO DENKO CORPORATION (JP) 2021-10-19 US disclosed
WO-2018152257-A1 LIQUID CRYSTAL COMPOSITION CONTAINING A FIVE-MEMBERED HETEROCYCLIC RING, REVERSE-MODE POLYMER DISPERSED LIQUID CRYSTAL ELEMENT, AND ASSOCIATED SELECTIVELY DIMMABLE DEVICE NITTO DENKO CORPORATION (JP) 2018-08-23 WO disclosed
CN-101972250-B Nitrogen compound1- [5- (butyl) -1, 3, 4-thiadiazol-2-yl]-nitrogen3Use of (3-chlorophenyl) urea UNIV BEIJING 2012-05-23 CN disclosed
CN-102216277-A Substituted benzamides as cannabinoid receptor ligands ABBOTT LAB 2011-10-12 CN disclosed
CN-102123993-A Imine derivatives as cannabinoid receptor ligands ABBOTT LAB 2011-07-13 CN disclosed
EP-2334670-A1 NEW 2-AMIDOTHIADIAZOLE DERIVATIVES Almirall S.A. (ES) 2011-06-22 EP disclosed
CN-102036984-A Novel compounds as cannabinoid receptor ligands ABBOTT LAB 2011-04-27 CN disclosed
CN-1746164-A Protein antagonist with water channel UNIV BEIJING (CN) 2006-03-15 CN disclosed
US-4018787-A HERBICIDES VELSICOL CHEMICAL CORPORATION (US) 1977-04-19 US disclosed